N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide

C23H30N2O2 — CID 43876397

IUPACN-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide
SMILESCOc1ccc(CN(C)C(=O)c2ccc(CN3CCCC(C)C3)cc2)cc1
InChIInChI=1S/C23H30N2O2/c1-18-5-4-14-25(15-18)17-20-6-10-21(11-7-20)23(26)24(2)16-19-8-12-22(27-3)13-9-19/h6-13,18H,4-5,14-17H2,1-3H3
InChIKeyYMQPXELWEAUWNF-UHFFFAOYSA-N
MW366.51 g/mol
LogP4.20
Rot. Bonds6

About N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide

N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide (PubChem CID 43876397) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide
PubChem CID43876397
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC NameN-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide
SMILESCOc1ccc(CN(C)C(=O)c2ccc(CN3CCCC(C)C3)cc2)cc1
InChIInChI=1S/C23H30N2O2/c1-18-5-4-14-25(15-18)17-20-6-10-21(11-7-20)23(26)24(2)16-19-8-12-22(27-3)13-9-19/h6-13,18H,4-5,14-17H2,1-3H3
InChIKeyYMQPXELWEAUWNF-UHFFFAOYSA-N
XLogP4.20
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(4-methylphenyl)methyl]-4-[[(3S)-3-methylpiperidin-1-yl]methyl]benzamide
CID 30379432
N-[(4-methoxyphenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide
CID 8991176
methyl 4-[[(3R)-3-methylpiperidin-1-yl]methyl]benzoate
CID 782095
(3S)-1-[(4-fluorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 38105345
N-[1-(4-methoxyphenyl)propyl]-4-[(3-methylpiperidin-1-yl)methyl]benzamide
CID 43876464
1-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]ethanone
CID 142372799
[1-[(4-methoxyphenyl)methyl]piperidin-3-yl] acetate
CID 46898261
4-[(3-methylpiperidin-1-yl)methyl]-N-propan-2-ylbenzamide
CID 43885844
N-methyl-4-[(3-methylpiperidin-1-yl)methyl]-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 132663656
1-(4-methoxyphenyl)-3-(3-methylpiperidin-1-yl)propan-1-one
CID 2984720
N-[(4-methoxyphenyl)methyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 8903596
methyl 4-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methylcarbamoyl]benzoate
CID 46474036

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide (CID 43876397) is N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide is COc1ccc(CN(C)C(=O)c2ccc(CN3CCCC(C)C3)cc2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide?
The InChIKey is YMQPXELWEAUWNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-18-5-4-14-25(15-18)17-20-6-10-21(11-7-20)23(26)24(2)16-19-8-12-22(27-3)13-9-19/h6-13,18H,4-5,14-17H2,1-3H3.
What are the key properties of N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide?
N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide has a molecular weight of 366.51 g/mol, XLogP of 4.20, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-N-methyl-4-[(3-methylpiperidin-1-yl)methyl]benzamide is sourced from PubChem (CID 43876397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).